Cas no 13878-08-5 (Propanedioic-1,3-14C2acid (9CI))
13878-08-5 structure
Product Name:Propanedioic-1,3-14C2acid (9CI)
CAS No:13878-08-5
MF:C3H4O4
MW:108.046544075012
CID:119994
PubChem ID:12200651
Update Time:2025-04-18
Propanedioic-1,3-14C2acid (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Propanedioic-1,3-14C2acid (9CI)
- MALONIC ACID, [1,3-14C]
- (1,3-14C2)Propanedioic acid
- Malonic acid,[1,3-14c]
- 13878-08-5
-
- Inchi： 1S/C3H4O4/c4-2(5)1-3(6)7/h1H2,(H,4,5)(H,6,7)/i2+2,3+2
- InChI Key： OFOBLEOULBTSOW-FTOQCNSHSA-N
- SMILES： O[14C](C[14C](=O)O)=O
Computed Properties
- Exact Mass: 108.01744258g/mol
- Monoisotopic Mass: 108.01744258g/mol
- Isotope Atom Count: 2
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 7
- Rotatable Bond Count: 2
- Complexity: 83.1
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -0.8
- Topological Polar Surface Area: 74.6?2
Propanedioic-1,3-14C2acid (9CI) Related Literature
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
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Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
13878-08-5 (Propanedioic-1,3-14C2acid (9CI)) Related Products
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